COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.574  -0.718   1.151  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.199  -0.609   1.154  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.197  -0.429  -1.239  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.571  -0.543  -1.256  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.271  -0.688  -0.058  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.745  -0.811  -0.068  1.00  0.00           C  
HETATM    7  N   UNL     1      -9.362  -1.511   0.882  1.00  0.00           N  
HETATM    8  N   UNL     1      -9.456  -0.221  -1.027  1.00  0.00           N1+
HETATM    9  N   UNL     1      -0.443   0.345   0.028  1.00  0.00           N  
HETATM   10  O   UNL     1      -2.647   1.039   0.080  1.00  0.00           O  
HETATM   11  C   UNL     1      -4.511  -0.464  -0.038  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.009  -0.339  -0.027  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.322   1.328   0.103  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.913   2.656   0.207  1.00  0.00           C  
HETATM   15  C   UNL     1       0.423   2.954   0.231  1.00  0.00           C  
HETATM   16  C   UNL     1       0.860   0.581   0.047  1.00  0.00           C  
HETATM   17  C   UNL     1       1.342   1.899   0.150  1.00  0.00           C  
HETATM   18  C   UNL     1       3.074   0.587   0.049  1.00  0.00           C  
HETATM   19  C   UNL     1       4.478   0.125   0.013  1.00  0.00           C  
HETATM   20  N   UNL     1       1.974  -0.228  -0.015  1.00  0.00           N  
HETATM   21  C   UNL     1       5.520   1.052   0.086  1.00  0.00           C  
HETATM   22  C   UNL     1       6.828   0.622   0.053  1.00  0.00           C  
HETATM   23  C   UNL     1       7.112  -0.741  -0.053  1.00  0.00           C  
HETATM   24  C   UNL     1       6.070  -1.668  -0.126  1.00  0.00           C  
HETATM   25  C   UNL     1       4.762  -1.238  -0.087  1.00  0.00           C  
HETATM   26  C   UNL     1       8.516  -1.203  -0.094  1.00  0.00           C  
HETATM   27  N   UNL     1       9.460  -0.418  -0.611  1.00  0.00           N1+
HETATM   28  N   UNL     1       8.837  -2.403   0.386  1.00  0.00           N  
HETATM   29  N   UNL     1       2.694   1.837   0.146  1.00  0.00           N  
HETATM   30  H   UNL     1      -7.110  -0.830   2.082  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.658  -0.636   2.088  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.654  -0.316  -2.166  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.106  -0.515  -2.194  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.845  -1.941   1.580  1.00  0.00           H  
HETATM   35  H   UNL     1     -10.329  -1.592   0.875  1.00  0.00           H  
HETATM   36  H   UNL     1      -9.007   0.290  -1.719  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.604  -0.750  -0.951  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.605  -0.888   0.823  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.647   3.446   0.267  1.00  0.00           H  
HETATM   40  H   UNL     1       0.760   3.977   0.311  1.00  0.00           H  
HETATM   41  H   UNL     1       1.978  -1.195  -0.090  1.00  0.00           H  
HETATM   42  H   UNL     1       5.301   2.106   0.167  1.00  0.00           H  
HETATM   43  H   UNL     1       7.634   1.339   0.110  1.00  0.00           H  
HETATM   44  H   UNL     1       6.290  -2.722  -0.208  1.00  0.00           H  
HETATM   45  H   UNL     1       3.957  -1.955  -0.143  1.00  0.00           H  
HETATM   46  H   UNL     1       9.226   0.456  -0.961  1.00  0.00           H  
HETATM   47  H   UNL     1       8.150  -2.974   0.763  1.00  0.00           H  
HETATM   48  H   UNL     1       9.758  -2.706   0.359  1.00  0.00           H  
HETATM   49  H   UNL     1     -10.422  -0.301  -1.034  1.00  0.00           H  
HETATM   50  H   UNL     1      10.381  -0.721  -0.638  1.00  0.00           H  
CONECT    1    2    2    5   30                                       
CONECT    2   11    1    1   31                                       
CONECT    3   11   11    4   32                                       
CONECT    4    3    5    5   33                                       
CONECT    5    4    4    1    6                                       
CONECT    6    8    8    5    7                                       
CONECT    7    6   34   35                                            
CONECT    8    6    6   36   49                                       
CONECT    9   16   13   13                                            
CONECT   10   13   12                                                 
CONECT   11   12    3    3    2                                       
CONECT   12   10   11   37   38                                       
CONECT   13    9    9   14   10                                       
CONECT   14   15   15   13   39                                       
CONECT   15   17   14   14   40                                       
CONECT   16   20   17   17    9                                       
CONECT   17   29   16   16   15                                       
CONECT   18   19   20   29   29                                       
CONECT   19   25   25   21   18                                       
CONECT   20   18   16   41                                            
CONECT   21   22   22   19   42                                       
CONECT   22   23   21   21   43                                       
CONECT   23   26   24   24   22                                       
CONECT   24   23   23   25   44                                       
CONECT   25   24   19   19   45                                       
CONECT   26   27   27   28   23                                       
CONECT   27   26   26   46   50                                       
CONECT   28   26   47   48                                            
CONECT   29   18   18   17                                            
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   28                                                      
CONECT   49    8                                                      
CONECT   50   27                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
